5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine

C11H17NO — CID 58584409

IUPAC5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine
SMILESCN1CCOC=C1C1=CCCCC1
InChIInChI=1S/C11H17NO/c1-12-7-8-13-9-11(12)10-5-3-2-4-6-10/h5,9H,2-4,6-8H2,1H3
InChIKeyYEJOYYCICPUULJ-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.29
Rot. Bonds1

About 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine

5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine (PubChem CID 58584409) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine.

Molecular Properties

Compound Name5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine
PubChem CID58584409
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine
SMILESCN1CCOC=C1C1=CCCCC1
InChIInChI=1S/C11H17NO/c1-12-7-8-13-9-11(12)10-5-3-2-4-6-10/h5,9H,2-4,6-8H2,1H3
InChIKeyYEJOYYCICPUULJ-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine?
The IUPAC name of 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine (CID 58584409) is 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine.
What is the SMILES notation for 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine?
The canonical SMILES for 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine is CN1CCOC=C1C1=CCCCC1.
What is the InChIKey of 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine?
The InChIKey is YEJOYYCICPUULJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-12-7-8-13-9-11(12)10-5-3-2-4-6-10/h5,9H,2-4,6-8H2,1H3.
What are the key properties of 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine?
5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine has a molecular weight of 179.26 g/mol, XLogP of 2.29, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexen-1-yl)-4-methyl-2,3-dihydro-1,4-oxazine is sourced from PubChem (CID 58584409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).